Data quality metrics extracted from 4khz.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "9c2c9fc94af89fcb100c3202a61a2d93",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 76.253,
    "b": 92.221,
    "c": 117.814,
    "alpha": 90.73,
    "beta": 101.68,
    "gamma": 103.60
  },
  "wavelengths": [1.07216],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,2.9],
    "number_observations_unique": 52859,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 77.1
      }
    ]
  }
}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):